Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | GLS | O94925 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL24977468 | 1.00 | POLB (0.53) | POLBHTTNPSR1L3MBTL1KMT2A | |
| SCHEMBL6372866 | 0.87 | POLB (0.44) | POLBHTTNPSR1L3MBTL1KMT2A | |
| SCHEMBL6372869 | 0.87 | POLB (0.44) | POLBHTTNPSR1L3MBTL1KMT2A | |
| SCHEMBL6372872 | 0.87 | POLB (0.44) | POLBHTTNPSR1L3MBTL1KMT2A | |
| SCHEMBL1999919 | 0.86 | POLB (0.53) | POLBHTTNPSR1L3MBTL1KMT2A | |
| SCHEMBL29889833 | 0.86 | POLB (0.53) | POLBHTTNPSR1L3MBTL1KMT2A | |
| SCHEMBL24977625 | 0.84 | KDM4E (0.43) | POLBHTTNPSR1L3MBTL1KMT2A | |
| SCHEMBL6387359 | 0.84 | POLB (0.55) | POLBHTTNPSR1L3MBTL1KMT2A | |
| SCHEMBL3385979 | 0.84 | POLB (0.51) | POLBHTTNPSR1L3MBTL1KMT2A | |
| SCHEMBL19920065 | 0.84 | POLB (0.47) | POLBHTTNPSR1L3MBTL1KMT2A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1129604-C | Amino acid derivatives and their use as thrombin inhibitors | ASTRA AB (SE) | 2003-12-03 | — | — | CN | disclosed |
| CN-1226895-A | Amino acid derivatives and their use as thrombin inhibitors | ASTRA AB (SE) | 1999-08-25 | — | — | CN | disclosed |